input word = C00000414

Metabolite InformationStructural formula
Name Hybridalactone
Formula C20H28O3
Mw 316.20384476
CAS RN 81892-88-8
C_ID C00000414 ,
InChIKey YJRNYEWLGNTSHT-WZEVMIHANA-N
InChICode InChI=1S/C20H28O3/c1-2-13-11-15(13)19-16-12-17-20(22-17)14(16)9-7-5-3-4-6-8-10-18(21)23-19/h3-4,7,9,13-17,19-20H,2,5-6,8,10-12H2,1H3/b4-3-,9-7-/t13-,14-,15+,16-,17+,19+,20-/m1/s1
SMILES [C@H]12C[C@@H]3[C@H]([C@H]1O2)/C=C\C/C=C\CCCC(=O)O[C@H]3[C@@H]1[C@@H](C1)CC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Cottoniella filamentosa Ref.
--Laurencia hybrida Ref.
--Platysiphonia miniata Ref.
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